(3S,4S)-1-[(3-pyrazol-1-ylphenyl)methyl]-4-(4-pyridin-2-ylpiperazin-1-yl)pyrrolidin-3-ol

Systemtic Name: (3S,4S)-1-[(3-pyrazol-1-ylphenyl)methyl]-4-(4-pyridin-2-ylpiperazin-1-yl)pyrrolidin-3-ol Openeye Name: (3S,4S)-1-[(3-pyrazol-1-ylphenyl)methyl]-4-[4-(2-pyridyl)piperazin-1-yl]pyrrolidin-3-ol CAS Name: (3S,4S)-1-[[3-(1-pyrazolyl)phenyl]methyl]-4-[4-(2-pyridinyl)-1-piperazinyl]-3-pyrrolidinol IUPAC Name: (3S,4S)-1-[(3-pyrazol-1-ylphenyl)methyl]-4-(4-pyridin-2-ylpiperazin-1-yl)pyrrolidin-3-ol Traditional Name: (3S,4S)-1-(3-pyrazol-1-ylbenzyl)-4-[4-(2-pyridyl)piperazino]pyrrolidin-3-ol Formula: C23H28N6O MolecularWeight: 404.50802

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2CN(CC2O)CC3=CC(=CC=C3)N4C=CC=N4)C5=CC=CC=N5

Isomeric SMILES

C1CN(CCN1[C@H]2CN(C[C@@H]2O)CC3=CC(=CC=C3)N4C=CC=N4)C5=CC=CC=N5

InChI

InChI=1S/C23H28N6O/c30-22-18-26(16-19-5-3-6-20(15-19)29-10-4-9-25-29)17-21(22)27-11-13-28(14-12-27)23-7-1-2-8-24-23/h1-10,15,21-22,30H,11-14,16-18H2/t21-,22-/m0/s1